4-[(2-methylphenyl)methyl]-2-{[4-(4-phenylpiperazine-1-carbonyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
4-[(2-methylphenyl)methyl]-2-{[4-(4-phenylpiperazine-1-carbonyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one
4-[(2-methylphenyl)methyl]-2-{[4-(4-phenylpiperazine-1-carbonyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | K788-9399 |
| Compound Name: | 4-[(2-methylphenyl)methyl]-2-{[4-(4-phenylpiperazine-1-carbonyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 545.7 |
| Molecular Formula: | C34 H31 N3 O2 S |
| Smiles: | Cc1ccccc1CN1C(/C(=C\c2ccc(cc2)C(N2CCN(CC2)c2ccccc2)=O)Sc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 6.8109 |
| logD: | 6.8108 |
| logSw: | -5.6681 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.978 |
| InChI Key: | ZAFSBDCAFVPWKI-UHFFFAOYSA-N |